HMDB0241926 RDKit 3D N-Palmitoyl Histidine 67 67 0 0 0 0 0 0 0 0999 V2000 7.7849 -1.6024 -0.0156 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6867 -0.8345 0.7052 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4487 -1.7204 0.6482 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2947 -1.0326 1.3468 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0529 -1.8166 1.3394 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3996 -2.2902 0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8900 -1.3356 -0.8737 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9046 -0.5151 -1.5653 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2572 0.3803 -2.6223 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2687 1.2899 -1.9924 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9432 2.1478 -0.9511 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9532 3.0829 -0.3441 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1704 2.3410 0.3361 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0871 3.4221 0.9188 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2441 2.8179 1.6256 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1294 2.0059 0.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9414 1.9274 -0.4789 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2179 1.2900 1.3012 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0857 0.4895 0.4286 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1527 -0.9187 0.9178 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9394 -1.8180 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3488 -3.0751 0.4594 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0039 -3.6377 -0.5665 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0086 -2.7585 -1.5693 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3506 -1.6277 -1.1775 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4728 1.0606 0.5325 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6540 2.0828 1.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5797 0.5746 -0.1029 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2491 -2.2767 0.7219 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5776 -0.8964 -0.3509 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3973 -2.1624 -0.8916 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0101 -0.6923 1.7488 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5340 0.1080 0.1514 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1628 -1.8622 -0.4096 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6472 -2.6806 1.1677 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6400 -1.0553 2.4758 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2794 0.0202 1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2810 -1.2975 2.0314 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2512 -2.7567 1.9888 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4766 -2.9397 0.4043 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0603 -3.0409 -0.4262 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1331 -0.6615 -0.3254 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2026 -1.8484 -1.6154 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6305 -1.1395 -2.1598 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5137 0.0610 -0.8859 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6981 -0.3180 -3.3028 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0394 0.8984 -3.2145 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4611 0.6787 -1.5665 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8049 1.9477 -2.7858 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 1.5000 -0.1436 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 2.7675 -1.4047 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4105 3.7930 0.3781 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4711 3.6382 -1.1982 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2405 1.7145 1.1746 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7039 1.6750 -0.3338 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4484 4.0525 1.5373 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3937 4.0301 0.0304 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7949 3.6401 2.1327 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8868 2.1663 2.4612 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4318 1.3076 2.3063 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7398 0.5613 -0.5895 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5297 -0.9453 1.9654 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1226 -1.3568 0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1991 -3.5837 1.4115 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4670 -2.9363 -2.5295 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2412 -0.8394 -1.8405 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8139 0.8003 -1.0477 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 19 26 1 0 26 27 2 0 26 28 1 0 25 21 1 0 1 29 1 0 1 30 1 0 1 31 1 0 2 32 1 0 2 33 1 0 3 34 1 0 3 35 1 0 4 36 1 0 4 37 1 0 5 38 1 0 5 39 1 0 6 40 1 0 6 41 1 0 7 42 1 0 7 43 1 0 8 44 1 0 8 45 1 0 9 46 1 0 9 47 1 0 10 48 1 0 10 49 1 0 11 50 1 0 11 51 1 0 12 52 1 0 12 53 1 0 13 54 1 0 13 55 1 0 14 56 1 0 14 57 1 0 15 58 1 0 15 59 1 0 18 60 1 0 19 61 1 0 20 62 1 0 20 63 1 0 22 64 1 0 24 65 1 0 25 66 1 0 28 67 1 0 M END